CAS 210490-71-4 | L-Tyrosine, L-alanyl-L-lysyl-L-tyrosyl-L-seryl- | CAS Number 210490-71-4

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210490-71-4 | L-Tyrosine, L-alanyl-L-lysyl-L-tyrosyl-L-seryl-

CAS No: 210490-71-4 Catalog No: AG002KT4 MDL No:

Product Description

Catalog Number:

AG002KT4

Chemical Name:

L-Tyrosine, L-alanyl-L-lysyl-L-tyrosyl-L-seryl-

CAS Number:

210490-71-4

Molecular Formula:

C30H42N6O9

Molecular Weight:

630.6893

IUPAC Name:

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-aminopropanoyl]amino]hexanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoic acid

InChI:

InChI=1S/C30H42N6O9/c1-17(32)26(40)33-22(4-2-3-13-31)27(41)34-23(14-18-5-9-20(38)10-6-18)28(42)36-25(16-37)29(43)35-24(30(44)45)15-19-7-11-21(39)12-8-19/h5-12,17,22-25,37-39H,2-4,13-16,31-32H2,1H3,(H,33,40)(H,34,41)(H,35,43)(H,36,42)(H,44,45)/t17-,22-,23-,24-,25-/m0/s1

InChI Key:

LOIOQPWEHQCRJL-QAMDWANKSA-N

SMILES:

NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)Cc1ccc(cc1)O)CO)Cc1ccc(cc1)O)NC(=O)[C@@H](N)C

Properties

Complexity:

970

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

630.301g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

630.699g/mol

Monoisotopic Mass:

630.301g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

266A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-2.8

Literature

Title	Journal
Purification and identification of angiotensin I-converting enzyme inhibitors from the red alga Porphyra yezoensis.	Journal of marine biotechnology 19980801